2(3H)-Thiazolethione, 4-(4-bromophenyl)-


Chemical Name: 2(3H)-Thiazolethione, 4-(4-bromophenyl)-
CAS Number: 2103-95-9
Product Number: AG002KOL(AGN-PC-0NJ390)
Synonyms:
MDL No:
Molecular Formula: C9H6BrNS2
Molecular Weight: 272.1846

Identification/Properties


Properties
MP:
220-224 °C
BP:
376.2±52.0 °C(Predicted)
Storage:
2-8℃;Inert atmosphere;
Form:
Solid
Computed Properties
Molecular Weight:
272.178g/mol
XLogP3:
3.2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
270.913g/mol
Monoisotopic Mass:
270.913g/mol
Topological Polar Surface Area:
69.4A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
244
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Danger
UN#:
2811
Hazard Statements:
H301-H315-H318-H335
Precautionary Statements:
P261-P280-P301+P310-P305+P351+P338
Class:
6.1
Packing Group:

NMR Spectrum


Other Analytical Data


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